Bromobenzene

Bromobenzene

SCHEMBL28025852

Brc1ccccc1.CCCCCCCCCCNC(C)=O

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 4/20 0.59
EPHX1 P07099 3/20 0.56
ALDH1A1 P00352 1/20 0.56
HTT P42858 1/20 0.56
MGLL Q99685 1/20 0.56
EGFR P00533 1/20 0.52
KDM4E B2RXH2 1/20 0.52
MAPK1 P28482 1/20 0.52
HIF1A Q16665 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
HPGD P15428 2/20 0.51
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Bromobenzene SCHEMBL28025843 0.93 HTT (0.54) NAAAEPHX1ALDH1A1HTTMGLL
Bromobenzene SCHEMBL28310421 0.86 L3MBTL1 (0.56) L3MBTL1HDAC3HDAC1HDAC2KMT2A
SCHEMBL1003218 0.80 KDM4E (0.80) NAAAEPHX1KDM4EMAPK1HIF1A
SCHEMBL8979293 0.80 KDM4E (0.80) NAAAEPHX1KDM4EMAPK1HIF1A
SCHEMBL1481880 0.80 KDM4E (0.80) NAAAEPHX1KDM4EMAPK1HIF1A
SCHEMBL25243376 0.80 KDM4E (0.80) NAAAEPHX1KDM4EMAPK1HIF1A
SCHEMBL14002535 0.80 KDM4E (0.80) NAAAEPHX1KDM4EMAPK1HIF1A
SCHEMBL7990903 0.80 KDM4E (0.80) NAAAEPHX1KDM4EMAPK1HIF1A
SCHEMBL2481694 0.80 KDM4E (0.80) NAAAEPHX1KDM4EMAPK1HIF1A
SCHEMBL559951 0.80 KDM4E (0.80) NAAAEPHX1KDM4EMAPK1HIF1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104817485-A Isoindigo derivative and preparation method thereof UNIV ANHUI NORMAL 2015-08-05 CN claimed
CN-104817485-A Isoindigo derivative and preparation method thereof UNIV ANHUI NORMAL 2015-08-05 CN disclosed